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88076-19-1 | 1H-Pyrazole, dihydro-5-methyl-1-phenyl-
CAS No: 88076-19-1 Catalog No: AG004KGU MDL No:
Product Description
Catalog Number:
AG004KGU
Chemical Name:
1H-Pyrazole, dihydro-5-methyl-1-phenyl-
CAS Number:
88076-19-1
Molecular Formula:
C10H12N2
Molecular Weight:
160.2157
IUPAC Name:
3-methyl-2-phenyl-1,5-dihydropyrazole
InChI:
InChI=1S/C10H12N2/c1-9-7-8-11-12(9)10-5-3-2-4-6-10/h2-7,11H,8H2,1H3
InChI Key:
NEVHAJQLJYUUDL-UHFFFAOYSA-N
SMILES:
CC1=CCNN1c1ccccc1
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.1g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
160.22g/mol
Monoisotopic Mass:
160.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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